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Atomistry » Chlorine » PDB 4tr9-4u19 » 4tx0 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Atomistry » Chlorine » PDB 4tr9-4u19 » 4tx0 » |
Chlorine in PDB 4tx0: The FK1 Domain of FKBP51 in Complex with (1S,5S,6R)-10-[(3,5- Dichlorophenyl)Sulfonyl]-5-(2-Methoxyethoxy)-3-(2-Methoxyethyl)-3,10- Diazabicyclo[4.3.1]Decan-2-OneEnzymatic activity of The FK1 Domain of FKBP51 in Complex with (1S,5S,6R)-10-[(3,5- Dichlorophenyl)Sulfonyl]-5-(2-Methoxyethoxy)-3-(2-Methoxyethyl)-3,10- Diazabicyclo[4.3.1]Decan-2-One
All present enzymatic activity of The FK1 Domain of FKBP51 in Complex with (1S,5S,6R)-10-[(3,5- Dichlorophenyl)Sulfonyl]-5-(2-Methoxyethoxy)-3-(2-Methoxyethyl)-3,10- Diazabicyclo[4.3.1]Decan-2-One:
5.2.1.8; Protein crystallography data
The structure of The FK1 Domain of FKBP51 in Complex with (1S,5S,6R)-10-[(3,5- Dichlorophenyl)Sulfonyl]-5-(2-Methoxyethoxy)-3-(2-Methoxyethyl)-3,10- Diazabicyclo[4.3.1]Decan-2-One, PDB code: 4tx0
was solved by
M.Bischoff,
C.Sippel,
A.Bracher,
F.Hausch,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Chlorine Binding Sites:
The binding sites of Chlorine atom in the The FK1 Domain of FKBP51 in Complex with (1S,5S,6R)-10-[(3,5- Dichlorophenyl)Sulfonyl]-5-(2-Methoxyethoxy)-3-(2-Methoxyethyl)-3,10- Diazabicyclo[4.3.1]Decan-2-One
(pdb code 4tx0). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the The FK1 Domain of FKBP51 in Complex with (1S,5S,6R)-10-[(3,5- Dichlorophenyl)Sulfonyl]-5-(2-Methoxyethoxy)-3-(2-Methoxyethyl)-3,10- Diazabicyclo[4.3.1]Decan-2-One, PDB code: 4tx0: Jump to Chlorine binding site number: 1; 2; Chlorine binding site 1 out of 2 in 4tx0Go back to Chlorine Binding Sites List in 4tx0
Chlorine binding site 1 out
of 2 in the The FK1 Domain of FKBP51 in Complex with (1S,5S,6R)-10-[(3,5- Dichlorophenyl)Sulfonyl]-5-(2-Methoxyethoxy)-3-(2-Methoxyethyl)-3,10- Diazabicyclo[4.3.1]Decan-2-One
Mono view Stereo pair view
Chlorine binding site 2 out of 2 in 4tx0Go back to Chlorine Binding Sites List in 4tx0
Chlorine binding site 2 out
of 2 in the The FK1 Domain of FKBP51 in Complex with (1S,5S,6R)-10-[(3,5- Dichlorophenyl)Sulfonyl]-5-(2-Methoxyethoxy)-3-(2-Methoxyethyl)-3,10- Diazabicyclo[4.3.1]Decan-2-One
Mono view Stereo pair view
Reference:
M.Bischoff,
C.Sippel,
A.Bracher,
F.Hausch.
Stereoselective Construction of the 5-Hydroxy Diazabicyclo[4.3.1]Decane-2-One Scaffold, A Privileged Motif For FK506-Binding Proteins. Org.Lett. V. 16 5254 2014.
Page generated: Sat Dec 12 11:14:03 2020
ISSN: ISSN 1523-7060 PubMed: 25286062 DOI: 10.1021/OL5023195 |
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